- InChI
- InChI=1S/C32H52N2O/c1-3-5-7-9-11-12-13-14-16-18-20-22-31-32(34-28-27-33-31)35-30-25-23-29(24-26-30)21-19-17-15-10-8-6-4-2/h23-28H,3-22H2,1-2H3
- InChI Key
- JGTVXBDSQFGHLZ-UHFFFAOYSA-N
- Formula
- C32H52N2O
- SMILES
-
CCCCCCCCCCCCCc1nccnc1Oc1ccc(CC
CCCCCCC)cc1 - Molecular Weight1
- 480.77
- CAS
- 2879-00-7
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 1.3241 | Relay (1.0) Calculated Property | |
| ΔfG° | 324.93 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -353.58 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 146.84 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.65 | eV | Relay (1.0) Calculated Property |
| log10WS | -9.45 | Relay (1.0) Calculated Property | |
| logPoct/wat | 10.415 | Crippen Calculated Property | |
| McVol | 440.050 | ml/mol | McGowan Calculated Property |
| Pc | 695.32 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 726.45 | K | Relay (1.0) Calculated Property |
| Tc | 968.38 | K | Relay (1.0) Calculated Property |
| Tfus | 314.13 | K | Relay (1.0) Calculated Property |
| Vc | 1.676 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-(P-n-nonylphenoxy)-3-tridecyl pyrazine.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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